CID 3075571

5-(2-chlorophenyl)-1-ethyl-2-imidazolidinethione

Structural Information

Molecular Formula
C11H13ClN2S
SMILES
CCN1C(CNC1=S)C2=CC=CC=C2Cl
InChI
InChI=1S/C11H13ClN2S/c1-2-14-10(7-13-11(14)15)8-5-3-4-6-9(8)12/h3-6,10H,2,7H2,1H3,(H,13,15)
InChIKey
INNNPHXHMAWGKJ-UHFFFAOYSA-N
Compound name
5-(2-chlorophenyl)-1-ethylimidazolidine-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.0488 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.05608 152.2
[M+Na]+ 263.03802 161.9
[M-H]- 239.04152 155.3
[M+NH4]+ 258.08262 170.2
[M+K]+ 279.01196 155.3
[M+H-H2O]+ 223.04606 145.9
[M+HCOO]- 285.04700 161.9
[M+CH3COO]- 299.06265 163.9
[M+Na-2H]- 261.02347 150.7
[M]+ 240.04825 152.0
[M]- 240.04935 152.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.